| CAS Number | 1134616-77-5 |
| Catalog Number | AG00IW98(AGN-PC-0WAY6E) |
| Chemical Name | sodium 3-methylquinoxaline-2-carboxylate |
| IUPAC Name | sodium;3-methylquinoxaline-2-carboxylate |
| InChI | InChI=1S/C10H8N2O2.Na/c1-6-9(10(13)14)12-8-5-3-2-4-7(8)11-6;/h2-5H,1H3,(H,13,14);/q;+1/p-1 |
| InChI Key | MKTKKQJBTCKSPH-UHFFFAOYSA-M |
| MDL Number | MFCD06656258 |
| Molecular Formula | C10H7N2NaO2 |
| Molecular Weight | 210.1645 |
| SMILES | [Na+].CC1=C(C([O-])=O)N=C2C(C=CC=C2)=N1 |
| Synonyms | Sodium 3-methylquinoxaline-2-carboxylate,
1134616-77-5,
3-Methylquinoxaline-2carboxylic acid sodium salt,
KS-000022RX,
AKOS025392408,
AS-7080,
OR310618,
EN300-233347,
3-Methylquinoxaline-2-carboxylic acid sodium salt,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.168g/mol |
| Monoisotopic Mass | 210.041g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 65.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number